2-(2,4-dichlorophenyl)-3-[2-(3,4-diethoxyphenyl)ethyl]quinazolin-4-one

Formula:C26H24N2O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(2,4-dichlorophenyl)-3-[2-(3,4-diethoxyphenyl)ethyl]quinazolin-4-one is not a drug-like molecule.

MolName	2-(2,4-dichlorophenyl)-3-[2-(3,4-diethoxyphenyl)ethyl]quinazolin-4-one
MolecularFormula	C26H24N2O3Cl2
Smiles	CCOc(ccc(CCN(C(c(ccc(Cl)c1)c1Cl)=Nc1c2cccc1)C2=O)c1)c1OCC
InChI	InChI=1S/C26H24Cl2N2O3/c1-3-32-23-12-9-17(15-24(23)33-4-2)13-14-30-25(19-11-10-18(27)16-21(19)28)29-22-8-6-5-7-20(22)26(30)31/h5-12,15-16H,3-4,13-14H2,1-2H3
InChIK	QTNLEYFKBIFQBX-UHFFFAOYSA-N
TotalMolweight	483.394
Molweight	483.394
MonoisotopicMass	482.116397
CLogP	6.1932
CLogS	-6.386
H Acceptors	5
TotalSurfaceArea	360.7
Relative PSA	0.13335
PolarSurfaceArea	51.13
Druglikeness	1.7327
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48485
Fragments	1
Non HAtoms	33
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	8
Amides	1
StereoCon

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